| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2010 | 16 | Yes |
Popular Name: (3S)-1-cyclopropyl-N-[[(3S)-3-piperidyl]methyl]pyrrolidin-3-amine (3S)-1-cyclopropyl-N-[[(3S)-3-pi…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 0.82 | 5.11 | -81.52 | 4 | 3 | 2 | 33 | 225.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 4.8 | -108.7 | 4 | 3 | 2 | 33 | 225.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 2.77 | -35.76 | 3 | 3 | 1 | 32 | 224.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.82 | 2.46 | -38.97 | 3 | 3 | 1 | 32 | 224.372 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.82 | 3.79 | -110.2 | 4 | 3 | 2 | 36 | 225.38 | 4 | ↓ |
